SMILES:
COc1cccc(F)c1Oc1cc(CN2CCN(C)CC2)ccc1NC(=O)Nc1nccs1Molecular Processing
Molecular formula
C23H26FN5O3S
Molecular weight
471.56
Exact mass
471.174
XLogP
4.47
TPSA
78.96
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
127
Supplementary Information
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